MassBank Record: JP003526

Home Search Record Index

O-METHOXYPHENOL; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP003526
RECORD_TITLE: O-METHOXYPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: O-METHOXYPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H8O2
CH$EXACT_MASS: 124.05243
CH$SMILES: COc(c1)c(O)ccc1
CH$IUPAC: InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3
CH$LINK: INCHIKEY LHGVFZTZFXWLCP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0023113

AC$INSTRUMENT: HITACHI RMU-6E
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0a4i-6900000000-49cb804087a42b1d1a22
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  38 2 20
  39 5.9 59
  50 3.7 37
  51 5.3 53
  52 6.3 63
  53 10.8 108
  55 2.3 23
  62 0.18 2
  63 3.9 39
  64 1.7 17
  65 4.9 49
  77 0.28 3
  80 1.7 17
  81 43.3 433
  82 2.5 25
  95 0.21 2
  109 99.99 999
  110 6.8 68
  121 1.4 14
  124 9 90
  125 7.3 73
//